General Information of the Compound
| Compound ID |
CP0259659
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| Compound Name |
3-(4-fluorophenyl)-N-(1-hydroxy-3H-2,1-benzoxaborol-6-yl)-5-methyl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C18H14BFN2O4
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| Molecular Weight |
352.13
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| Canonical SMILES |
Cc1onc(c1C(=O)Nc1ccc2COB(O)c2c1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C18H14BFN2O4/c1-10-16(17(22-26-10)11-2-5-13(20)6-3-11)18(23)21-14-7-4-12-9-25-19(24)15(12)8-14/h2-8,24H,9H2,1H3,(H,21,23)
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| InChIKey |
JELFHMNDZWDROS-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound